# generated using pymatgen data_Er5Fe3(P3Ir4)4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 12.47211256 _cell_length_b 12.47211266 _cell_length_c 3.95067093 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000492 _symmetry_Int_Tables_number 1 _chemical_formula_structural Er5Fe3(P3Ir4)4 _chemical_formula_sum 'Er5 Fe3 P12 Ir16' _cell_volume 532.20814104 _cell_formula_units_Z 1 loop_ _symmetry_equiv_pos_site_id _symmetry_equiv_pos_as_xyz 1 'x, y, z' loop_ _atom_site_type_symbol _atom_site_label _atom_site_symmetry_multiplicity _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy Er Er0 1 0.66666700 0.33333300 0.00000000 1.0 Er Er1 1 0.33333300 0.66666700 0.00000000 1.0 Er Er2 1 0.81880582 0.81880582 0.50000000 1.0 Er Er3 1 0.18119418 1.00000000 0.50000000 1.0 Er Er4 1 1.00000000 0.18119418 0.50000000 1.0 Fe Fe5 1 0.29380332 0.29380332 0.50000000 1.0 Fe Fe6 1 0.70619668 1.00000000 0.50000000 1.0 Fe Fe7 1 1.00000000 0.70619668 0.50000000 1.0 P P8 1 0.68885027 0.16617249 0.50000000 1.0 P P9 1 0.83382751 0.52267778 0.50000000 1.0 P P10 1 0.47732222 0.31114973 0.50000000 1.0 P P11 1 0.16617249 0.68885027 0.50000000 1.0 P P12 1 0.52267778 0.83382751 0.50000000 1.0 P P13 1 0.31114973 0.47732222 0.50000000 1.0 P P14 1 0.64250276 0.64250276 0.00000000 1.0 P P15 1 0.35749724 0.00000000 0.00000000 1.0 P P16 1 0.00000000 0.35749724 0.00000000 1.0 P P17 1 0.18096039 0.18096039 0.00000000 1.0 P P18 1 0.81903961 0.00000000 0.00000000 1.0 P P19 1 0.00000000 0.81903961 0.00000000 1.0 Ir Ir20 1 0.80621576 0.17967906 0.00000000 1.0 Ir Ir21 1 0.82032094 0.62653670 0.00000000 1.0 Ir Ir22 1 0.37346330 0.19378424 0.00000000 1.0 Ir Ir23 1 0.17967906 0.80621576 0.00000000 1.0 Ir Ir24 1 0.62653670 0.82032094 0.00000000 1.0 Ir Ir25 1 0.19378424 0.37346330 0.00000000 1.0 Ir Ir26 1 0.45861423 0.45861423 0.00000000 1.0 Ir Ir27 1 0.54138577 0.00000000 0.00000000 1.0 Ir Ir28 1 0.00000000 0.54138577 0.00000000 1.0 Ir Ir29 1 0.86729928 0.36075670 0.50000000 1.0 Ir Ir30 1 0.63924330 0.50654358 0.50000000 1.0 Ir Ir31 1 0.49345642 0.13270072 0.50000000 1.0 Ir Ir32 1 0.36075670 0.86729928 0.50000000 1.0 Ir Ir33 1 0.50654358 0.63924330 0.50000000 1.0 Ir Ir34 1 0.13270072 0.49345642 0.50000000 1.0 Ir Ir35 1 0.00000000 0.00000000 0.00000000 1.0